2-[4-[2,2-bis(fluoranyl)-2-[1,1,2,2,2-pentakis(fluoranyl)ethoxy]ethoxy]phenyl]-5-octyl-pyrimidine

Systemtic Name: 2-[4-[2,2-bis(fluoranyl)-2-[1,1,2,2,2-pentakis(fluoranyl)ethoxy]ethoxy]phenyl]-5-octyl-pyrimidine Openeye Name: 2-[4-[2,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]phenyl]-5-octyl-pyrimidine CAS Name: 2-[4-[2,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]phenyl]-5-octylpyrimidine IUPAC Name: 2-[4-[2,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]phenyl]-5-octylpyrimidine Traditional Name: 2-[4-[2,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]phenyl]-5-octyl-pyrimidine Formula: C22H25F7N2O2 MolecularWeight: 482.434922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(OC(C(F)(F)F)(F)F)(F)F

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(OC(C(F)(F)F)(F)F)(F)F

InChI

InChI=1S/C22H25F7N2O2/c1-2-3-4-5-6-7-8-16-13-30-19(31-14-16)17-9-11-18(12-10-17)32-15-20(23,24)33-22(28,29)21(25,26)27/h9-14H,2-8,15H2,1H3